(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
2
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
3
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
4
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
5
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
6
|
c1ccc2c(c1)nc(c3n2cnn3)Nc4cc(ccc4O)Cl
|
|
7
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
8
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
9
|
c1ccc(cc1)c2cc(no2)c3ncon3
|
|
10
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
11
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
12
|
C1CCC2(C1)NC(CO2)(CO)CO
|
|
13
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
14
|
CCOC(=O)C1=C2C(=C(C(=N2)O)C(=O)OCC)N=C1O
|
|
15
|
COC(=O)Nc1cc(c[nH]1)C(=O)c2ccc(cc2Cl)Cl
|
|
16
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
17
|
Cc1nc(on1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
18
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
19
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
20
|
Cc1cc(no1)C(=O)Nc2cccc(c2)c3[n-]nnn3
|
|
21
|
CCSc1[nH]c(c(n1)C)CC(C)C
|
|
22
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
23
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
24
|
c1cc([nH]c1)/C=C/c2cccs2
|
|
25
|
c1ccc2c(c1)cc([nH]2)c3nnco3
|
|
26
|
Cc1cccc(c1)NC(=O)n2cccn2
|
|
27
|
CN1C(=[NH2+])[C@H]([NH+]=C1C2CCCC2)c3cccc(c3)Cl
|
|
28
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
29
|
|
|
30
|
c1cc([nH]c1)c2nnc(nn2)c3ccc[nH]3
|
|
31
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
32
|
c1cnn(c1)c2cncc(n2)N3CCCC3
|
|
33
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
34
|
CCOC(=O)c1c(n(c(=O)s1)c2ccccc2)N
|
|
35
|
Cn1c(c(cn1)c2nc(no2)C3CC3)N
|
|
36
|
c1cc(c(cc1Cl)c2cc([nH]n2)C(F)(F)F)O
|
|
37
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
38
|
Cc1c(cc2c(c(sc2n1)c3nnc(o3)C)N)C(=O)C
|
|
39
|
CCC(=O)Oc1c(c(c([nH]1)C)C(=O)C)C
|
|
40
|
c1ccc2c(c1)cc3c(n2)OC(=O)N(C3)C4CC4
|
|
41
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
42
|
CS(=O)(=O)N1CC[C@@H](C1)c2[nH]c3cccnc3n2
|
|
43
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
44
|
c1ccc(cc1)COn2ccnc2
|
|
45
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
46
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
47
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
48
|
Cn1c(cc(n1)C(=O)OC)OC(=O)c2ccco2
|
|
49
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
50
|
c1ccc(cc1)CSc2ccn[nH]2
|
|
51
|
COc1ccc(cc1)c2cnnn2Cc3ccco3
|
|
52
|
c1ccc(cc1)/C=C/C=C/c2cc[nH]n2
|
|
53
|
CC(=O)O[C@H]1C[C@@H]2C=C[C@](C1)(O2)CN(C)C(=O)OC
|
|
54
|
C1CCC(CC1)NC(=O)CC2CCCO2
|
|
55
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
56
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
57
|
c1cc(ccc1[C@@H]2CN=CC=N2)[C@@H]3CN=CC=N3
|
|
58
|
c1cc(ccc1C2=CC=NS(=O)(=O)N2)Cl
|
|
59
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
60
|
c1cc(oc1)C(=O)Nc2nc(co2)C(=O)[O-]
|
|
61
|
c1cc(oc1)C(=O)n2ccc(n2)c3cccs3
|
|
62
|
Cc1csc(n1)[C@@H](C#N)C(=O)Cn2cnc(n2)C#N
|
|
63
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
64
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
65
|
Cc1cc([nH]n1)OCCC#N
|
|
66
|
Cn1c2cc([nH]c2nc1SC)C(=O)OC
|
|
67
|
c1cc(cnc1)Sc2cc3c(cc2O)CCO3
|
|
68
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
69
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
70
|
C1CSCC1C2[NH]NC(N2)C3CCSC3
|
|
71
|
c1cc(oc1)c2ccc(nc2)C#N
|
|
72
|
Cc1ccc(cc1)C#Cc2ccco2
|
|
73
|
C[C@@]1(CCC=C1CC(=O)[O-])c2ccccc2
|
|
74
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
75
|
CCCCc1[nH]cc([nH+]1)CO
|
|
76
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
77
|
c1cc(cnc1)c2cn3c(c(n2)N)nc(n3)c4ccco4
|
|
78
|
c1cnn(c1)c2ccc(cc2)c3cnco3
|
|
79
|
CCOC(=O)/C=C(/c1cnc2n1cccc2)C(F)(F)F
|
|
80
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
81
|
Cc1c(non1)c2ccn[nH]2
|
|
82
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
83
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
84
|
CCOC(=O)C1=CNc2ccccc2N=C1N
|
|
85
|
C([C@@H]1[C@@H]([C@@H]([C@@H](O1)O)O)O)O
|
|
86
|
COc1c(nccn1)N2CCC(CC2)NS(=O)(=O)C
|
|
87
|
CC1=NC2CCCCC2N[C@@H](C1)C3CCOC3
|
|
88
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
89
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
90
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
91
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
92
|
|
|
93
|
CCOC(=O)C1=C(O[C@@H](C1)C2CCCCC2)N
|
|
94
|
c1ccc2c(c1)c3cc(c(cc3o2)n4cccc4)N
|
|
95
|
C1CC2C(CC1CC3CC[NH]C3)OCO2
|
|
96
|
c1ccc(cc1)NC(=O)OCn2cncn2
|
|
97
|
|
|
98
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
99
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
100
|
Cc1c(nnc(c1C#N)NCc2ccoc2)C
|
|
101
|
CCOc1ccc(cc1)NCC2=CCNC=C2
|
|
102
|
c1ccc(cc1)[C@H]2C[C@](N=C(N2)N)(C(F)(F)F)O
|
|
103
|
c1ccc(cc1)[C@@H]2C=C(OC(=N2)N)c3ccccc3
|
|
104
|
Cc1[nH]nc(n1)c2ccccc2
|
|
105
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
106
|
CCOC(=O)C1=NC2=CCn3ccnc3C2=C1
|
|
107
|
CCO[C@@H](C)C(=O)/N=c/1[nH]c(n[nH]1)c2ccc(s2)C
|
|
108
|
Cc1nc(cs1)c2nc(no2)c3ccc(cc3)CO
|
|
109
|
Cc1csc(n1)c2cc3ccccc3oc2=O
|
|
110
|
COc1ccc(cc1)C2=Nc3ccccc3SCN2
|
|
111
|
|
|
112
|
C[C@@]1(COC(=N1)COc2ccccc2)CO
|
|
113
|
c1ccn2c(c1)n/c(=NC(=O)c3ccco3)/s2
|
|
114
|
c1c2c(sc1C(=O)Nc3nc[nH]n3)CCCCCC2
|
|
115
|
Cc1c[nH]/c(=NC(=O)OC(C)(C)C)/[nH]1
|
|
116
|
Cc1ccc(cc1)c2c(c(=O)c2=O)NCCOC
|
|
117
|
CC[C@@H](C(=O)/N=C/1N=CN=N1)Oc2ccccc2
|
|
118
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
119
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
120
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
121
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
122
|
C[C@H]1OC[C@@H]([C@@H](O1)/C=C/C(=C/C(=O)OC)/C)O
|
|
123
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
124
|
c1cc(sc1)NC(=O)NCC2CC2
|
|
125
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
126
|
c1ccc(cc1)Sc2ccc(o2)CO
|
|
127
|
|
|
128
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
129
|
Cc1c([nH]c(c1C#N)N)Cc2ccccc2
|
|
130
|
c1ccc2c(c1)[nH]c(n2)NC3=NC(=O)C(=N3)[O-]
|
|
131
|
COC1CCC(CC1)C2=NCC2(CL)CL
|
|
132
|
CCCc1cc(no1)c2cc(=O)n3c([nH]2)c(c(n3)C)CC
|
|
133
|
c1cc(sc1)C(=O)c2ccc(nn2)Cl
|
|
134
|
CN1CN(c2c1cccc2)CC(=O)c3ccccc3
|
|
135
|
c1ccc(cc1)C[C@@H]2CCOC(=O)N2
|
|
136
|
CC[C@@H](c1cnn(c1)C)NC(=O)c2c(ocn2)C
|
|
137
|
COc1ccc(cc1)C2=NCCc3c2ccs3
|
|
138
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
139
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
140
|
[H]/N=c/nc(ss1)SCc2ccc(cc2)C(=O)OC
|
|
141
|
CNc1nc(ns1)C23CC4CC(C2)CC(C4)C3
|
|
142
|
C[C@@H](n1cncn1)Oc2cccc(c2)Cl
|
|
143
|
CCOC(=O)c1c(c2c(snc2s1)C)N
|
|
144
|
c1nc([nH]n1)OC23CC4CC(C2)CC(C4)C3
|
|
145
|
CC(C)(C)C(=O)CC1=NC(=O)/C(=Cc2csnn2)/S1
|
|
146
|
c1ccc(cc1)CN2C=N[C@@H]3[C@@H]2N=C(N=C3N)Cl
|
|
147
|
c1ccc(cc1)c2c(nc([nH]2)c3ccco3)N
|
|
148
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
149
|
CCOC(=O)c1ccc(cc1)n2c(=O)oc(n2)C
|
|
150
|
Cn1cccc1c2csc(n2)c3ccco3
|
|
151
|
CC1(COC(=N1)/C=C/c2ccccc2)C
|
|
152
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
153
|
Cc1c(c([nH]c1C)/C=C/C(=C(C=N2)C)C)C
|
|
154
|
CC1NCC(N1CC2CCCCC2)[C@@H](C3CCCO3)O
|
|
155
|
c1ccc(cc1)/C=C/c2ccncn2
|
|
156
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
157
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
158
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
159
|
C[C@H]([C@@H]1[C@@H](NC1=O)CC(=O)OC)O
|
|
160
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
161
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
162
|
c1ccc(cc1)C#CC#CC#N
|
|
163
|
CCO[C@@H]1CCC(=CO1)[S@@](=O)C2CCC(CC2)C
|
|
164
|
C[C@@H](c1ccc(c(c1)F)c2ccccc2)c3cc(on3)N
|
|
165
|
Cn1cc(nc1C(=O)[O-])NC(=O)c2cccs2
|
|
166
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
167
|
CCCNC(=O)Cc1nc[nH]n1
|
|
168
|
COC(=O)c1c(=O)n([nH]n1)Cc2cccs2
|
|
169
|
c1cc(ccc1C#N)C2=C[C@@H]3C=CSC3=N2
|
|
170
|
Cc1ccc(cc1)OC(=O)OCSc2[n-]nnn2
|
|
171
|
CN(C)C(=O)NCCN1CCCCCc2c1cccc2
|
|
172
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
173
|
c1ccc(cc1)n2cc3c(n2)Nc4ccccc4O3
|
|
174
|
C([C@H](c1c(c(c(o1)O)[O-])O)O)O
|
|
175
|
C1CC([NH]C1)C(=O)OCC#N
|
|
176
|
Cc1nc(on1)/C=C/c2ccccc2O
|
|
177
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
178
|
CC#CC(=O)COC/C(=C/C=C)/C
|
|
179
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
180
|
c1ccnc(c1)SCCn2cccn2
|
|
181
|
C1CCC(CC1)C[S@@](=O)C2CCCCC2CN3CCCC3
|
|
182
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
183
|
CC(=O)NCCn1cccn1
|
|
184
|
c1ccc2c(c1)nn(n2)c3cc(n[nH]3)O
|
|
185
|
CC(=O)C#C/C=C/c1ccccc1
|
|
186
|
c1ccc(cc1)OCc2ccco2
|
|
187
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
188
|
COc1ccc(cc1)c2nnc3n2NCS3
|
|
189
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
190
|
Cn1ccc(=NC(=O)c2ccccc2)cc1
|
|
191
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
192
|
COC(=O)C#CC1=CCCCC1
|
|
193
|
c1ccc2c(c1)CCN(C2)C/C(=N/c3nccs3)/[O-]
|
|
194
|
Cc1nc(cs1)c2cc(no2)c3nnc(o3)[O-]
|
|
195
|
c1ccc(cc1)c2ncc(s2)c3ccno3
|
|
196
|
|
|
197
|
|
|
198
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
199
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
200
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
201
|
c1ccc(cc1)Cn2c(c(nn2)C3=NCCO3)N
|
|
202
|
c1ccc(cc1)C(=O)CC2=CCCCC2
|
|
203
|
C[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)c2nc3c(cccn3n2)N)O)O)O
|
|
204
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
205
|
|
|
206
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
207
|
c1ccc(cc1)c2csc(n2)n3cccn3
|
|
208
|
CC[C@@]1(Cc2ccccc2O1)c3[nH]ccn3
|
|
209
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
210
|
CC(=CCC/C(=C/CO)/C)C
|
|
211
|
|
|
212
|
Cc1ccc2c(c1)n3c([nH+]2)NCCC3
|
|
213
|
c1ccc(cc1)NC(=O)Nc2ccno2
|
|
214
|
CCOC(=O)NC1[NH]N(C(=O)N1)C2CCCCN2
|
|
215
|
c1cc(oc1)OC(=O)[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
216
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
217
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
218
|
c1cc2c(cc1C(F)(F)F)nc(s2)c3csnn3
|
|
219
|
Cc1cc(sn1)NC(=O)c2ccco2
|
|
220
|
C1CNC([NH]1)[C@@H]2CCCCN2C(=O)C3CC3
|
|
221
|
c1cnc(nc1c2nccs2)N
|
|
222
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
223
|
c1ccc2c(c1)CCN2CC(=O)N3[C@H]4CC[C@@H]3c5c(nns5)C4
|
|
224
|
COC(=O)N1CCC(CC1)c2cc(=O)[nH]s2
|
|
225
|
C1CC(CCC1/C/2=C/C(=O)OC3CC(CCC3C[C@@H]2O)O)O
|
|
226
|
c1cnn(c1)c2cncc(n2)Cl
|
|
227
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
228
|
C[C@@]1(C(OC(=O)N1CCc2ccco2)(C)C)O
|
|
229
|
Cc1ccc(n1c2c(ccs2)c3cc([nH]n3)N)C
|
|
230
|
c1ccc(cc1)OCc2nnco2
|
|
231
|
|
|
232
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
233
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
234
|
CCCCC1CCC(CC1)c2nc(no2)N
|
|
235
|
CC1NNC(O1)NC(=O)C2CCC(CC2)C#N
|
|
236
|
c1ccc(cc1)NCCn2cccc2
|
|
237
|
Cc1ncc2c(n1)-c3cc(ccc3SC2)F
|
|
238
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
239
|
CC(=O)O/C=C/c1ccccc1
|
|
240
|
c1ccc(cc1)Nc2ccccn2
|
|
241
|
Cc1cnc(o1)CN2CCc3c2cccc3
|
|
242
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
243
|
Cn1cnnc1Cc2ccccc2
|
|
244
|
CCOC(=O)C1CC(=O)OC(=O)[NH]1
|
|
245
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
246
|
CNC(=O)N/C=C/c1ccco1
|
|
247
|
c1ccc(cc1)SCn2cncn2
|
|
248
|
c1ccc(cc1)n2c(nc(n2)[O-])c3cccs3
|
|
249
|
|
|
250
|
c1c([nH]nn1)SCC(=O)N
|
|
251
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
252
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
253
|
c1cc(cnc1)[C@@H]2Cc3cc(ccc3O2)C#N
|
|
254
|
CC(=O)NCCc1c[nH+]c[nH]1
|
|
255
|
C1CCC2C(C1)N[C@@H](S2)C3CCC[NH]3
|
|
256
|
Cc1ccc(c(c1)n2c(c(cn2)n3cncn3)O)C
|
|
257
|
Cc1nnc(s1)SCSc2ccccn2
|
|
258
|
C1CCC(CC1)[C@@H]2CC(=O)OC2
|
|
259
|
c1ccc(cc1)CCn2cnnn2
|
|
260
|
CCOC(=O)/C=C/1CCC=C1N2CCOCC2
|
|
261
|
Cc1cc2nnc3c(c(c(nc3n2n1)N)C#N)N
|
|
262
|
CC(=CCC/C(=C/C=C)/C)C
|
|
263
|
c1ccc2c(c1)c3c([nH]2)nc4c(n3)non4
|
|
264
|
c1ccc(cc1)n2nc3ccc4c(c3n2)nc(cn4)N
|
|
265
|
c1cc(oc1)CNC(=O)n2ccnc2
|
|
266
|
COC(=O)CC1=C(NC(=NC1)N2CCCC2)O
|
|
267
|
CC1(C(=NC(=O)O1)c2ccc(cc2)F)C
|
|
268
|
c1cc(cnc1)C2=NC(=O)C3(N2)CCCC3
|
|
269
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
270
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
271
|
C[C@@H](Cn1cc(cn1)Cl)c2cc(=O)[nH]c(n2)NC(C)C
|
|
272
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
273
|
Cc1nc(cs1)C#C[C@@H]2C=CC=NC2=O
|
|
274
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
275
|
c1cc2c(cc1Cl)cc(o2)SCC(=O)[O-]
|
|
276
|
c1ccc(cc1)C(=O)[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
277
|
c1ccc2c(c1)/C(=N/c3[nH]c4ccccc4n3)/NC2=O
|
|
278
|
Cc1ccc(cc1)S(=O)(=O)Cc2c([nH]c(=O)[nH]2)C
|
|
279
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
280
|
C1CCC(CC1)CC2CCC[NH]2
|
|
281
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
282
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
283
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
284
|
c1cc(oc1)/C=C/c2ccco2
|
|
285
|
C[C@@H]1CC[C@@H](C1)NC2=NCCO2
|
|
286
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
287
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
288
|
Cc1c2c(n(n1)c3ccccc3)N[S@@](=O)N2
|
|
289
|
COC(CNC1=Nc2c(cccn2)OC1)OC
|
|
290
|
c1cc(oc1)c2csc(n2)CC#N
|
|
291
|
c1ccc2c(c1)ncn2n3cccc3
|
|
292
|
C1CCC(CC1)C2=N[C@@H]3C4CCCCC4[C@H]2O3
|
|
293
|
c1ccc(cc1)n2c(nc(n2)Cl)c3ccco3
|
|
294
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
295
|
CCNC(=O)Oc1c2ccccc2on1
|
|
296
|
|
|
297
|
CC[C@@H](c1nc(no1)C)NCc2cn(nc2C)CC=C
|
|
298
|
CN1C(=C/C(=C/2N=NC(=[NH2+])O2)/NC1=O)[O-]
|
|
299
|
Cc1c(nc(o1)c2ccoc2)CN3CCC[C@H]3C(=O)OC
|
|
300
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
301
|
|
|
302
|
C[C@@]1(C(OC(=O)N1CCc2c[nH+]c[nH]2)(C)C)O
|
|
303
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
304
|
c1cnoc1c2nc(no2)CS(=O)(=O)c3ccsc3
|
|
305
|
Cc1nnc(n1c2ccc(cc2)OC)Sc3ccccn3
|
|
306
|
c1ccc(cc1)NC(=O)NC23CC4CC(C2)CC(C4)C3
|
|
307
|
C1CCC(CC1)n2c(=O)c(n[nH]2)C#N
|
|
308
|
Cc1cccc(c1)NC2=NCCO2
|
|
309
|
Cc1ccc(s1)[C@@H]2CCCc3c2cccc3
|
|
310
|
c1ccc(cc1)c2cc3n(c2)c4ccccc4n3N
|
|
311
|
C/N=c/1scc(s1)C23CC4CC(C2)CC(C4)C3
|
|
312
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
313
|
CC(C)(C)NC(=O)c1ccc(cc1)Cl
|
|
314
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
315
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
316
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
317
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
318
|
CCO/C=CCC1(CCCC1)O
|
|
319
|
Cc1nc(cs1)c2nc(cs2)C(=O)C
|
|
320
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
321
|
C/C=C/C=C/C1=CC(=O)CCN1
|
|
322
|
Cc1ccc2c(c1)S/C(=C(/C(=O)OC)C(F)(F)F)/O2
|
|
323
|
Cnccs/c1=NC(=O)c2ccc[nH]2
|
|
324
|
CN(CCn1cccn1)c2ccccc2
|
|
325
|
c1ccc(cc1)SCc2cnc(s2)Cl
|
|
326
|
c1cc(nc(c1)F)n2c(c(cn2)n3cncn3)O
|
|
327
|
COC(=O)c1c(ccs1)Oc2ncccn2
|
|
328
|
C/C=C/[C@@H]1OCC[C@@](O1)(C)C(=O)C2CCCCC2
|
|
329
|
c1ccc(cc1)Cc2ccn[nH]2
|
|
330
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
331
|
CS(=O)(=O)NCc1ccccn1
|
|
332
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
333
|
CCCCc1ccc(cc1)On2ccc(=O)cc2
|
|
334
|
c1cc(ccc1C#N)OC(=O)Cc2ccsc2
|
|
335
|
Cc1nc(cs1)[C@@H]2COc3ccccc3O2
|
|
336
|
CCOc1cc(no1)Oc2ccccc2
|
|
337
|
c1cc([nH]c1)c2nnc(o2)SCC(F)(F)F
|
|
338
|
CC1=C(CCO1)C(=O)NCCO
|
|
339
|
CC(=O)c1ccc-2c(c1)-c3c2cccc3
|
|
340
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
341
|
COC(=O)c1cc2c([nH]1)cc(nc2Cl)Cl
|
|
342
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
343
|
c1ccc2c(c1)ccn2Cc3cnc(s3)Cl
|
|
344
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
345
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
346
|
Cc1ccc(o1)C(=O)Cc2c(=O)oc3ccccc3n2
|
|
347
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
348
|
Cc1ccc(cc1)NC2=NC(=[NH+]C(N2)(C)C)N
|
|
349
|
CCN(CC)CC#CC1=CCCC1
|
|
350
|
c1ccc-2c(c1)CSc3c2nc(nc3)N
|
|
351
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
352
|
COC(=O)c1cc2c(o1)Sc3ccccc3NC2=O
|
|
353
|
C/C=C/[C@@H]1OC[C@H](O1)c2ccccc2
|
|
354
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
355
|
c1ccc(cc1)CNc2ncco2
|
|
356
|
CCC/N=c/c(=N/c2cccnc2)/c(c1O)O
|
|
357
|
Cc1[nH]c(c[nH+]1)c2ccnc(n2)SC
|
|
358
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
359
|
c1c(c(n(n1)C(=O)CCN2CCOC2=O)N)C#N
|
|
360
|
c1ccc2c(c1)Nc3cc(ccc3S2)c4cc[nH]n4
|
|
361
|
C1CCC(CC1)[C@@H]2C[C@@H]2NC3=NCCO3
|
|
362
|
c1c([nH]nc1C(=O)[O-])C2CC2
|
|
363
|
c1cc(oc1)c2cc(n[nH]2)O
|
|
364
|
C1CCN(C(=O)C1)[C@@H]2C[C@@H]([C@@H](O2)CO)O
|
|
365
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
366
|
c1cc2=CC=CNc2c3c1=CC=CN3
|
|
367
|
c1nc([nH]n1)/N=C(/NC(C(F)(F)F)C(F)(F)F)[O-]
|
|
368
|
Cc1c(n(ccc1=O)CCc2c[nH]cn2)C
|
|
369
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
370
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
371
|
c1cc(c(nc1)c2ccsc2)N
|
|
372
|
Cc1ccc(cc1)c2ccc[nH]2
|
|
373
|
c1cc(cnc1)[C@H]2[NH+]=c3c(=[N+]2[O-])cccn3
|
|
374
|
c1ccc(cc1)c2cnn3c2NC(=O)[C@@H](C3)CC(=O)[O-]
|
|
375
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
376
|
C1NC([NH]N1)NC2=NCCO2
|
|
377
|
COC(=O)C#Cc1cccs1
|
|
378
|
CCOC(=O)/C=C/1[C@@](C2CCCCC2O1)(C)O
|
|
379
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
380
|
Cc1c(c(on1)C)Cn2nc(nn2)c3ccco3
|
|
381
|
COC(=O)Oc1c(c2c(s1)nc3ccccc3n2)N
|
|
382
|
CC(=O)NCn1cc(c(=O)o1)c2ccc(cc2)c3ccccn3
|
|
383
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
384
|
|
|
385
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
386
|
Cc1nnc(o1)CSc2nccn2C
|
|
387
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
388
|
CC1(Cc2cccc(c2O1)Oc3ccc(cn3)C#N)C
|
|
389
|
c1ncn(n1)C[C@@H]2COC3(O2)CCCCC3
|
|
390
|
c1ccc(cc1)[C@@H]2C(=O)NC(=O)O2
|
|
391
|
c1cc(sc1)c2ccon2
|
|
392
|
c1coc2c1[nH]c(c2)C(=O)[O-]
|
|
393
|
CCn1cc(cn1)Nc2c(cccn2)C#N
|
|
394
|
C[C@@H](c1cccc(c1)n2cccc2)NS(=O)(=O)C
|
|
395
|
c1cc(c2c(c1)[nH]c(=O)o2)N
|
|
396
|
c1ccc(cc1)CC2=CC(=O)[C@H](C=N2)[O-]
|
|
397
|
c1cc(ccc1C2=C(N=CC2)c3ccncc3)F
|
|
398
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2cccs2
|
|
399
|
C([C@@H](CO)O)N1C(=O)SC(N1)N
|
|
400
|
CC(C)(C)c1csc(n1)c2ccc(nc2)n3cncn3
|
|
401
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
402
|
c1cc(cc(c1)OCc2cscn2)N
|
|
403
|
COC(=O)c1cc2cc(oc2[nH]1)C#N
|
|
404
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
405
|
c1cn(cn1)Cc2cnc(s2)Cl
|
|
406
|
c1cc(oc1)CSc2nccs2
|
|
407
|
CCOC(=O)CC/C=C/C#C
|
|
408
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccccn3)O
|
|
409
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
410
|
CCOC(=O)c1cc2c3ccccc3oc2s1
|
|
411
|
Cc1cc(nc2c1c3c(s2)c(n[nH]3)c4ccccc4)C
|
|
412
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
413
|
CN1C=CC(=CC2CCCCC2)C=C1
|
|
414
|
c1ccc(cc1)Oc2ccc(o2)CO
|
|
415
|
c1ccc(cc1)S(=O)(=O)[C@@H]2CC(=O)N2
|
|
416
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
417
|
C[C@@H](n1ccnc1)OCc2ccc(cc2)F
|
|
418
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
419
|
C(C[C@@H]([C@@H](CO)O)O)CO
|
|
420
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
421
|
CCC(=O)CC/C=C/C#CC#CC#CC
|
|
422
|
CC(C)(C)OC(=O)N1CCC(=CC1)c2ccccn2
|
|
423
|
C[C@@H]1CSc2c1ncc(c2)C(=O)OC
|
|
424
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
425
|
c1cc(cnc1)[C@@H]2NC(CO2)(CO)CO
|
|
426
|
CCOc1nnc(s1)CN2CCc3ccccc3C2
|
|
427
|
COC(=O)/C=c/1c(=O)n2c(=NCC2)s1
|
|
428
|
c1c2c([nH]c1C(=O)[O-])nco2
|
|
429
|
CC(C)/C=C/C1=CC2=C(C1)Cc3c2cccc3
|
|
430
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
431
|
Cc1cnc(o1)CSc2ccccc2
|
|
432
|
c1ccnc(c1)C#CC2=CCCC2
|
|
433
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
434
|
CCNC(=O)C#CC(=O)NCC
|
|
435
|
c1cc(oc1)CSc2nnc(c(=O)n2N)Nc3nccs3
|
|
436
|
c1ccc(cc1)c2c3c([nH]n2)CCC3
|
|
437
|
c1cc(oc1)c2nccs2
|
|
438
|
c1cc(cc(c1)N)C2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
439
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
440
|
CCCCN1CCc2cccc(c2SC1)C
|
|
441
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
442
|
CC1CC(N(N1)C2=N[C@@]3([C@@](N2)(NC(=O)N3)C)C)C
|
|
443
|
Cc1nc(no1)CSc2nncs2
|
|
444
|
c1cc2c(cc1c3nccs3)CC=C2
|
|
445
|
c1cnccc1CSc2nncs2
|
|
446
|
Cn1c2c(cn1)nc([nH]2)c3ccccc3
|
|
447
|
c1ccc(cc1)CCc2csnn2
|
|
448
|
C/C=C/C[C@@]1(C(=N1)C2CCCCC2)C
|
|
449
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
450
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
451
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
452
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
453
|
c1cc(ccc1C2=NC(=CC2)c3ccncc3)Cl
|
|
454
|
c1cc(oc1)c2cn3c(n2)sc(n3)c4ccco4
|
|
455
|
c1ccc(cc1)O[C@@H]2C[C@H]3CC[C@@H]2[C@@H]4[C@@H]3C=C4
|
|
456
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
457
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
458
|
Cc1ccc2c(c1)nc3c(n2)sc(=O)s3
|
|
459
|
Cc1c(cc(o1)c2ccno2)S(=O)(=O)NC
|
|
460
|
c1cc(ccc1SCCCCn2cncn2)Cl
|
|
461
|
COc1c2c([nH]n1)nncn2
|
|
462
|
Cc1nnc(s1)SCN2CCN(CC2)c3ccccc3
|
|
463
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
464
|
CCCCCC(=O)OCC#C
|
|
465
|
c1ccc(c(c1)C(=O)c2cnoc2)O
|
|
466
|
Cc1cc(nc(n1)N2C(=O)CC(=N2)N)C
|
|
467
|
c1ccc2c(c1)C3c4ccccc4C2O3
|
|
468
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
469
|
COc1cccc(c1)[C@@H]2N=C(C(=O)O2)Cc3ccco3
|
|
470
|
c1ccc2c(c1)nc(o2)c3ccco3
|
|
471
|
COC(=O)c1c(cc(s1)n2cccn2)O
|
|
472
|
c1ccc2c(c1)nc(s2)n3cnc(n3)C#N
|
|
473
|
c1ccc(c(c1)C(=O)O[C@@H]2Cn3c(nnn3)SC2)Cl
|
|
474
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
475
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
476
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
477
|
Cc1c(c(on1)N)c2nc(cs2)c3ccc(cc3)OC
|
|
478
|
c1ccc(cc1)C2=CC(=O)OC2
|
|
479
|
Cc1ccc(o1)SCc2ccco2
|
|
480
|
CCOC(=O)C=C1NCCN1
|
|
481
|
C1CC1NC(=O)C2(CC2)C#N
|
|
482
|
c1ccc(cc1)c2nc(cs2)c3ccn[nH]3
|
|
483
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
484
|
c1ccc2c(c1)N[C@@H]3C[C@H](N2)O[C@@H]3[C@H](CO)O
|
|
485
|
C[C@@H](C#N)NC(=O)N[C@@H](C)C(=O)N
|
|
486
|
C1CC1N2C[C@@H](CC2=O)CO
|
|
487
|
c1ccc(cc1)Nc2nccs2
|
|
488
|
c1ccnc(c1)Nc2cccs2
|
|
489
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
490
|
Cc1nnc(o1)c2c(oc(n2)c3ccccc3)N
|
|
491
|
CS(=O)(=O)NC[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
492
|
Cc1ccc(cc1)OCn2cc(cn2)N
|
|
493
|
c1cc(ccc1NC(=O)Cc2ncon2)F
|
|
494
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
495
|
c1nc(c(n1CCO)N)C#N
|
|
496
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
497
|
CC1(COC(=N1)c2ccco2)C
|
|
498
|
|
|
499
|
CC#CC#Cc1cccc(=O)o1
|
|
500
|
c1cc(ccc1C2=C/C(=C/3C=C(C=CC3=O)Cl)/ON2)F
|
|
501
|
c1cc(oc1)C(=O)c2cccs2
|
|
502
|
CCO/C(=C/C1=NC(=O)[C@@](C1)(C(F)(F)F)[O-])/[O-]
|
|
503
|
c1cc(ccc1[C@@H]2CCN3C(=[NH+]2)N=NN3)Br
|
|
504
|
CCOC(=O)Cc1[nH]ncn1
|
|
505
|
Cc1cc(n(n1)c2nc(cs2)C)C
|
|
506
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
507
|
c1ccc(cc1)C2=COc3ccccc3O2
|
|
508
|
c1ccc(cc1)NC(=O)Nc2nc[nH]n2
|
|
509
|
c1c2c(cc3c1OCO3)-c4c(c(=O)c4=O)CC2
|
|
510
|
|
|
511
|
CC(C)N1CNc2nc(nn2C1)C(F)(F)F
|
|
512
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
513
|
CC(=O)N[C@@H]1Cc2c1cccc2
|
|
514
|
CCc1ccc(cc1)N2C(=O)CC(=O)N=C2O
|
|
515
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
516
|
c1ccc(cc1)CNc2cnoc2
|
|
517
|
CCOC(=O)N/C=CNC(=O)OCC
|
|
518
|
CCOC(=O)N=[S@@](=O)(c1ccccc1)N
|
|
519
|
c1ccn(c1)C2CCN(CC2)CCC#N
|
|
520
|
CN(c1ccccc1)c2ccc(s2)OC
|
|
521
|
Cc1cc(no1)CSc2ccccn2
|
|
522
|
c1ccnc(c1)SCc2ccco2
|
|
523
|
c1cc(ccc1N2CCC(=C2[O-])C(=O)/N=c/3[nH]ccs3)F
|
|
524
|
c1ccc(cc1)/C=C/c2cc(cc(=O)o2)[O-]
|
|
525
|
c1ccc(cc1)[C@@H]2CC(=O)NC2
|
|
526
|
Cc1nnc(s1)[C@@H]2CCCN(C2)C(=O)C
|
|
527
|
Cc1cnc(o1)COc2ccccc2
|
|
528
|
Cc1c(c(on1)N)C2=CCN(CC2)C(=O)C
|
|
529
|
c1cc(ccc1C2=C(CCC2)c3ccncc3)F
|
|
530
|
CCOC(=O)c1c(c(c([nH]1)c2c(nc3ccccc3n2)C)C#N)N
|
|
531
|
c1cc(oc1)/C=C/c2nn3cnnc3s2
|
|
532
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
533
|
c1cc(oc1)C2=NN3C(=N[C@H]4CCCC[C@H]4C35CCCCC5)N2
|
|
534
|
C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O)NC(=O)C)O
|
|
535
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
536
|
c1cc2c(c(c1)F)CC(=O)N2
|
|
537
|
c1ccc(cc1)Sc2[nH]ncn2
|
|
538
|
Cc1nc2cc([nH]c2s1)C(=O)[O-]
|
|
539
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
540
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
541
|
Cc1ccc(cc1)S(=O)(=O)N/C(=N/c2[nH]ncn2)/[O-]
|
|
542
|
CCOC(=O)c1[nH]nc(n1)N
|
|
543
|
c12c(non1)N[C@@H]3[C@@H](N2)NC(=O)N3
|
|
544
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
545
|
[H]/N=C/1CC(=O)N=C2N1N=C(S2)CCC
|
|
546
|
c1cc2c(cc1c3cc[nH]n3)CCO2
|
|
547
|
Cn1c2ccccc2nc1Nc3c(=O)[nH]c(=O)[nH]n3
|
|
548
|
c1ccc(cc1)C(=O)O[C@@H]2CC(=O)N2
|
|
549
|
Cc1cc(n(n1)c2nc3c(c4ccccc4[nH]3)nn2)C
|
|
550
|
|
|
551
|
|
|
552
|
Cc1nc-2c(s1)CCc3c2cccc3
|
|
553
|
c1cc2c(cc1C(=O)[O-])N[C@@H](N2)C(F)(F)F
|
|
554
|
c1ccc(cc1)c2c3c(cc(cn3)C(F)(F)F)[nH]n2
|
|
555
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
556
|
C1CCC2C(C1)CC[C@@H]2CC3CCCCN3
|
|
557
|
c1cc(oc1)c2nc3c(cc(cn3n2)C(=O)N4CCCC4)N
|
|
558
|
c1ccc(cc1)n2cc3cnnc(c3n2)[O-]
|
|
559
|
c1cnn(c1)CCSc2nncs2
|
|
560
|
CC(=O)NCc1ccccn1
|
|
561
|
Cc1ccccc1SCCN2CCOC2=O
|
|
562
|
CCOC(=O)C1CC(CN1C)N2C3CCCCC3NN2
|
|
563
|
c1ccc(cc1)S(=O)(=O)NCc2nccs2
|
|
564
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
565
|
c1cc(ccc1C2=CCn3c(nnn3)N2)F
|
|
566
|
CCCCS(=O)(=O)NCc1nccn1C
|
|
567
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
568
|
c1nc(nn1CCC#N)N=N=N
|
|
569
|
Cc1ccc(cc1)[C@@H]2Cc3c(c[nH]n3)C(=O)C2
|
|
570
|
Cc1c(c[nH]n1)C(=O)N2CCn3c(nc(n3)C)C2
|
|
571
|
c1cc(sc1)CSc2ccc(cc2)O
|
|
572
|
c1ccc-2c(c1)-c3c2nc4ccccc4n3
|
|
573
|
c1ccc(cc1)Sc2cnns2
|
|
574
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
575
|
Cn1cc(cn1)NC(=O)c2cncn2c3ccccc3
|
|
576
|
CC1(OC(=CC(=O)O1)CC(=O)c2ccco2)C
|
|
577
|
c1ccc2c(c1)CCN2c3nc4ccccc4o3
|
|
578
|
c1ccc(cc1)/C=C/c2csnn2
|
|
579
|
c1cc(ccc1F)SN2CCOCC2
|
|
580
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
581
|
CC(=O)NC1C=CC(C=C1)CC[C@@H](C(=O)[O-])NC(=O)C
|
|
582
|
c1ccc(cc1)/C=C/c2nnc(o2)N
|
|
583
|
CCn1cc(cn1)Nc2nccc(n2)OC
|
|
584
|
c1c(nc[nH]1)C2(CCCC2)O
|
|
585
|
c1ccc(cc1)C(=O)c2ccco2
|
|
586
|
c1ccnc(c1)/C=C/c2ccco2
|
|
587
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
588
|
c1ccc(cc1)Cn2ccnn2
|
|
589
|
CC(=O)n1cc(cc1c2ccccc2)OC(=O)C
|
|
590
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
591
|
Cc1cc(oc1)c2ccccc2
|
|
592
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
593
|
CCC(=O)N/C=C/c1ccccc1
|
|
594
|
CCOC(=O)[C@@H]1c2c(c(c([nH]2)C)C)S[C@@H]1C
|
|
595
|
CN1CCO[C@@H]1c2ccccc2
|
|
596
|
CC1CCC(CC1)N2C=C(CC2=O)C3CCCCC3
|
|
597
|
c1cc2c(nc1)nc(o2)N3CCCC3
|
|
598
|
c1cc(sc1)[C@H]2C=N[C@@H]3C=CC=C[C@@H]3N2
|
|
599
|
Cc1nnc(n1N)Sc2nccc(n2)OC
|
|
600
|
c1cc2c(cc1Cn3cnnc3)OCO2
|
|
601
|
c1ccc(cc1)CCC(=O)n2cnnc2N
|
|
602
|
c1ccc(cc1)Oc2cncc3c2cc(s3)c4[n-]nnn4
|
|
603
|
CCOC(=O)C1=C(NC(=O)N[C@@H]1C)c2cccs2
|
|
604
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
605
|
CCCc1nn2c(nnc2o1)c3ccccc3
|
|
606
|
c1ccc(cc1)S[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
607
|
|
|
608
|
c1cnccc1c2csc(n2)c3cnc[nH]3
|
|
609
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
610
|
C1CCC(CC1)(C2=COCCO2)O
|
|
611
|
c1ccc(cc1)C2=C3[C@@H](CCC2)C(=O)C(=O)O3
|
|
612
|
c1ccc2c(c1)CCc3ccccc3NC2
|
|
613
|
C1CCC2C(C1)NC3N2[N-]C(N3)C4CCCO4
|
|
614
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
615
|
c1cc(cnc1)N2CC[C@H]3C[NH2+][C@H]3C2
|
|
616
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
617
|
C[C@H](CCc1ccco1)Nc2ncccn2
|
|
618
|
Cc1ccc(cc1)C2=Cc3ccccc3NC=C2
|
|
619
|
c1cc(cnc1)C(=O)c2ccco2
|
|
620
|
CC(=O)c1ccc2=c3cc(ccc3=c2c1)C(=O)C
|
|
621
|
CC(=O)NCCc1coc2c1ccnc2
|
|
622
|
CCOc1nnc(o1)[N-]S(=O)(=O)c2ccc(cc2)N
|
|
623
|
Cc1nc(cs1)C#Cc2ccccn2
|
|
624
|
c1cc([nH]c1)C(=O)c2ccco2
|
|
625
|
Cc1ccc(cc1)Nc2nc(=[NH2+])ss2
|
|
626
|
CC1(Cc2c(nc(c(n2)N)C(=O)OC)CO1)C
|
|
627
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
628
|
Cn1ccc(n1)C#CCN2CCOCC2
|
|
629
|
c1ccc2c(c1)nnn2/C=C/c3ccc[nH]3
|
|
630
|
COC1=COC(=C(O1)O)C2CCC(CC2)F
|
|
631
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
632
|
C1Cc2c(onc2c3c4c(on3)CCC4)C1
|
|
633
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
634
|
c1cc(nnc1n2cncn2)[O-]
|
|
635
|
Cn1cc(cn1)c2nnc(o2)SC
|
|
636
|
C1CCC(CC1)NSC2CCCCC2
|
|
637
|
Cc1nc-2c(s1)Cc3c2ccc(c3)OC
|
|
638
|
c1cc2c(cc1C#N)CCCC=C2
|
|
639
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
640
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
641
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
642
|
c1cc(ccc1C(=O)COC(=O)CCn2cnnn2)F
|
|
643
|
Cc1cc(nc(n1)Nn2c3ccccc3[nH]c2=O)C
|
|
644
|
c1ncn(n1)C(=O)NC2CCCCC2
|
|
645
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
646
|
Cn1c2c(cn1)[C@@H](CCC2)Nc3c(cccn3)C#N
|
|
647
|
CC(=O)Nc1cc2c(s1)C3(CCCCC3)CC(=O)N2
|
|
648
|
Cc1c(c([nH]n1)c2ccccc2)N
|
|
649
|
CCOC(=O)[C@@H](CC#N)C#N
|
|
650
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
651
|
C=CCNC1CCNC(N1)N
|
|
652
|
CCOC(=O)[C@@H]1C=C1C(C)(C)O
|
|
653
|
c1cc(oc1)CNn2cnnc2
|
|
654
|
Cc1nc(cs1)/C=C/c2cccnc2
|
|
655
|
C=CCc1cc2nccn2cn1
|
|
656
|
C1C2CC3CC1CC(C2)(C3)c4nsc(=O)o4
|
|
657
|
c1ccc(cc1)Nc2nc(ns2)N
|
|
658
|
Cc1c(sc2n1cc(c2)c3ccccc3)C
|
|
659
|
CC(C)NC(=O)CSc1cnnn1c2ccccc2F
|
|
660
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
661
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
662
|
c1ccnc(c1)/N=C/C[C@@H](C(F)(F)F)O
|
|
663
|
C1CCC(CC1)[C@@H]/2CC3CCCCC3C(=O)O/C=C2
|
|
664
|
c1ccc(cc1)c2c3c(c4ccccc4o3)[nH]n2
|
|
665
|
Cc1nccn1C(=O)c2cccs2
|
|
666
|
c1ccc(cc1)OCc2[n-]nnn2
|
|
667
|
c1ccc(cc1)c2cc(c(o2)n3cccc3)C#N
|
|
668
|
c1ccc(cc1)[C@H](C(=O)[C@H]2C=CC=N2)O
|
|
669
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
670
|
CCC/C=C/COC(=O)N(C)C
|
|
671
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
672
|
c1cc(sc1)C2=CC[C@@H](C(=O)N2)C#N
|
|
673
|
c1ccc-2c(c1)Cc3c2ccc(c3)n4cccc4
|
|
674
|
C=CCNC(=O)c1ccco1
|
|
675
|
CCOc1cc2c(cc1F)nnc(n2)C
|
|
676
|
|
|
677
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
678
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
679
|
Cc1csc(n1)Cc2nc3ccccc3n2C
|
|
680
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
681
|
CCOC(=O)c1ccc2c(c1)[nH]c(c2O)c3ccccc3
|
|
682
|
CCc1cccc([o+]1)c2ccccc2
|
|
683
|
c1ccc(cc1)C2=CC[C@@](C=C2)(C#N)F
|
|
684
|
CCCC(=O)OCOC(=O)/C=C(C)/N
|
|
685
|
CC1C(OC(N1)NC(=O)N(C)C2CC2)C
|
|
686
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
687
|
c1ccc(cc1)c2cccnn2
|
|
688
|
|
|
689
|
c1cc2c([nH]nc2Cl)nc1
|
|
690
|
CNC(=O)NCNC(=O)NC
|
|
691
|
CCC(=O)OC/C=C/C=C/C
|
|
692
|
|
|
693
|
|
|
694
|
CCOC(=O)Cc1coc(n1)C
|
|
695
|
Cc1cc(co1)C(=O)n2ccnc2
|
|
696
|
C1CCC(CC1)C(=O)NN2CCNN2
|
|
697
|
CC1(C(=O)N=C(N1)Nc2nc3ccccc3o2)C
|
|
698
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
699
|
C1CC(=CC[C@@H]1CC(=O)[O-])c2nc(on2)C3CC3
|
|
700
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
701
|
c1cc(cnc1)CNCCc2ccco2
|
|
702
|
c1cc(sc1)C(=O)[C@@H]2CCC(=O)O2
|
|
703
|
|
|
704
|
CN(C)C(=O)OCOC(=O)N(C)C
|
|
705
|
COc1cccc(c1)S(=O)(=O)[C@@H]2CC=NC2
|
|
706
|
c1ccnc(c1)CCSc2nncs2
|
|
707
|
Cn1cc(cn1)NCc2ccco2
|
|
708
|
c1ccc(cc1)Cc2nnco2
|
|
709
|
CC1(Cc2ccccc2-c3n1nnn3)C
|
|
710
|
CC1(c2ccccc2C(=[O+]1)c3ccc(cc3)OC)C
|
|
711
|
CC1(OC(=CC(=O)O1)c2ccccc2)C
|
|
712
|
Cc1c(sc(n1)C)c2cc3ccccc3[nH]2
|
|
713
|
CSc1c(c([nH]n1)c2ccco2)C#N
|
|
714
|
Cc1c(cnn1c2ccccc2)c3nnc(o3)[O-]
|
|
715
|
CC(=O)N1[C@H]2C[C@@H]([C@H]1c3ccccc3)[C@@H]2OC(=O)C
|
|
716
|
C[C@H]1[C@@H]([C@H](C=CO1)O)OCc2ccccc2
|
|
717
|
C1CCC(CC1)[C@@H]2CCC(=O)N2
|
|
718
|
c1ccc2c(c1)C(=O)N[C@@H](O2)c3ccco3
|
|
719
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
720
|
c1ccc2c(c1)c(=O)c(c[nH]2)C(=O)Nc3nccs3
|
|
721
|
|
|
722
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
723
|
c1cc(ccc1CC/C=C
2ccnc2)Cl
|
|
724
|
c1cnoc1c2nnc(o2)N
|
|
725
|
COC(=O)c1cn(nn1)CN2CCC(CC2)C#N
|
|
726
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
727
|
c1ccc(cc1)[C@H]2[C@H](C(=O)N2)O
|
|
728
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
729
|
C1CC(CCC=C1)CCC(=O)N
|
|
730
|
c1ccc(cc1)NC2=Nc3ccccc3CCC2
|
|
731
|
Cc1[nH]c2c(n1)C(=O)CCC2
|
|
732
|
CCOC(=O)c1cccnn1
|
|
733
|
C=CCn1c(=O)n(c(=O)n(c1=O)CC=C)CCn2cccn2
|
|
734
|
C1CCC2C(C1)[C@@H](CCS2)NC3CNCC(N3)CL
|
|
735
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
736
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
737
|
c1ccc-2c(c1)Cc3c2nncc3
|
|
738
|
C[C@@H]1COC(=N1)C2CCCCN2
|
|
739
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
740
|
c1ccc(cc1)CC2=C(C=NC(=O)C2)C(=O)N
|
|
741
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
742
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
743
|
CC1(C=CN(C=C1)CCC(=O)OC)C
|
|
744
|
CC1=Nc2c(cnn2C)C(=O)CC1
|
|
745
|
C1CCC(CC1)C2=N[C@@H]2COC(=O)C3CCC(CC3)BR
|
|
746
|
COC(=O)c1cc-2c(s1)C(=O)c3c2cccc3
|
|
747
|
c1ccc2c(c1)c(n[nH]2)n3cccc3
|
|
748
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
749
|
[H]/N=C/N[C@@]2(c3ccccc3C(=O)[C@]2(N1)O)O
|
|
750
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
751
|
c1cc(cnc1)C2=NCC(=N2)C#N
|
|
752
|
c1ccc2c(c1)c(=O)n3n2C[C@@H](C3)O
|
|
753
|
Cc1cc(=O)[nH]c2c1CCO2
|
|
754
|
Cc1cc(no1)c2c(c(no2)C)CO
|
|
755
|
CN1CC(CN1)NS(=O)(=O)C2CCCS2
|
|
756
|
c1ccc(cc1)C2=CCNn3cnnc3S2
|
|
757
|
CCO[C@@H]1C=C(Oc2c1cccc2)c3ccc(cc3)F
|
|
758
|
c1ccc(cc1)NC(=O)c2nnc(s2)C(F)(F)F
|
|
759
|
c1ccc2c(c1)-c3c(c[nH]n3)CO2
|
|
760
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
761
|
c1ccnc(c1)N[C@@H]2C[C@@H]3[C@H](O2)[C@@H](CO3)O
|
|
762
|
c1ccc(cc1)Cn2cccc2
|
|
763
|
CCS(=O)(=O)n1c(cc(n1)c2ccccc2)N
|
|
764
|
Cc1nnc(o1)C(=O)Nc2ccccc2
|
|
765
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
766
|
c1ccc2c(c1)OC[C@@H](O2)c3ncc(c(n3)N)C#N
|
|
767
|
|
|
768
|
Cc1cc(nc(n1)N)n2c(cc(n2)c3ccco3)C(F)(F)F
|
|
769
|
c1nncn1c2[n-]c(nn2)N
|
|
770
|
C[C@@H](Cc1ccco1)NS(=O)(=O)C
|
|
771
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
772
|
C1CC(OC1)C(=O)CN2CCC(=O)CC2O
|
|
773
|
CC1CN(C2C1-C3C(CN[NH]3)CC2)C
|
|
774
|
|
|
775
|
COC(=O)c1cc2c(cccn2)oc1=O
|
|
776
|
CCCC[C@@]1(CN(C(=O)OC1)C)CC
|
|
777
|
Cc1cc(no1)c2nn3cnnc3s2
|
|
778
|
c1c[nH]c2c1c(cc(c2)F)N
|
|
779
|
c1cnc(c2c1n(nn2)[C@@H]3C[C@@H](OC3)CO)N
|
|
780
|
CC(=O)Oc1c(ccs1)N
|
|
781
|
|
|
782
|
|
|
783
|
COC(=O)c1cc2c(s1)CN(C2)c3ccccc3Cl
|
|
784
|
CC1=C(CC(=O)N1Cc2ccco2)C(=O)OC
|
|
785
|
c1ccc2c(c1)ncc(n2)Oc3cnns3
|
|
786
|
Cc1c([nH]n(c1=O)C2=NCCN2)c3ccccc3
|
|
787
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
788
|
C1CSC2N1CC(N2)CN3CNC(N3)C#N
|
|
789
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
790
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
791
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
792
|
c1ccc(cc1)c2nnc(s2)Oc3ccc4ccc(=O)oc4c3
|
|
793
|
c1cc(ccc1[C@@H](c2ccns2)O)F
|
|
794
|
CC(=O)Oc1coc2c1cccc2
|
|
795
|
Cn1cccc1CCn2ccnc2
|
|
796
|
Cc1cc(no1)c2nc(on2)C(C)(C)C
|
|
797
|
CCOC(=O)C1=CN/C(=C(/O)OCC)/C1=O
|
|
798
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
799
|
C(c1nnc(o1)N)c2nnc(o2)N
|
|
800
|
[H]/N=c/n2c(c(s1)c3ccccc3)NCC2
|
|
801
|
c1c(noc1N)C2CCCC2
|
|
802
|
CN(C)c1nnnn1c2cccnc2
|
|
803
|
c1ccc(cc1)[C@@H](c2c[nH]nc2)O
|
|
804
|
Cc1c(c(n[nH]1)C)Sc2ccccc2
|
|
805
|
c1ccc(cc1)C(=O)c2c3ccccn3nn2
|
|
806
|
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C=C1)O
|
|
807
|
c1ccc(cc1)Oc2ccoc2
|
|
808
|
C=CC[C@@H]1CCCCC(=O)N1
|
|
809
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
810
|
CCn1cc(cn1)c2cc[nH]n2
|
|
811
|
|
|
812
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
813
|
CCC/C=C/c1ccc(s1)C
|
|
814
|
C1CCC(CC1)S(=O)(=O)C2=C[C@@H](C[C@@H]2O)O
|
|
815
|
COC1CCC2C(C1)CC=CO2
|
|
816
|
Cc1c(c(n[nH]1)n2ccnc2)N
|
|
817
|
C1CC2(CC2)[C@@H]3[C@@H]1NC(=O)C3
|
|
818
|
Cc1nc(cs1)c2ccc3c(c2)CCN3
|
|
819
|
c1ccc2c(c1)nc(c3n2ccc3)n4cccc4
|
|
820
|
C#CCOc1ccc(cc1)F
|
|
821
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
822
|
c1ccc2c(c1)[nH]c(n2)Nn3cnnc3
|
|
823
|
CC(=O)N1CCC=C1Cc2ccccc2
|
|
824
|
C[C@@H]([C@@](C(C)C)(C(=O)OC1=CCN2[C@H]1[C@H](CC2)O)O)OC
|
|
825
|
C1=CC2=CC(=O)O[C@@H]2[C@@H]([C@@H]1O)O
|
|
826
|
CC(C)(C#C)NC(=O)COC
|
|
827
|
|
|
828
|
C1CCC/2C(C1)CC(=O)C3CCCCC3/C=C2
|
|
829
|
C([C@@H](CO)O)N1C(=O)[NH+]C(S1)N
|
|
830
|
CCc1nnc(s1)[N-]S(=O)(=O)N2CCCCC2
|
|
831
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
832
|
CCS(=O)(=O)NCCn1cccn1
|
|
833
|
C[C@@H](c1ccc(nn1)Cl)NC(=O)OCc2ccccc2
|
|
834
|
c1cc2cc(sc2nc1)CO
|
|
835
|
c1cc(cc2c1cc3c([o+]2)/C=Cc4ccc(cc4OC3=O)O)O
|
|
836
|
c1ccc(cc1)COc2c(nccn2)N
|
|
837
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
838
|
C1CCC2(C1)NC3=C(CCC3)C(=O)N2
|
|
839
|
CCc1nc2ccccc2c(=O)n1N
|
|
840
|
Cc1cn2c(nc(nc2n1)c3ccccc3)N
|
|
841
|
C1CCC2C(C1)C3C([NH]2)C(=O)C(CS3)C#N
|
|
842
|
COc1ccc(cc1)c2cn3c(s2)ncn3
|
|
843
|
Cc1cc(n(n1)CNc2nccs2)C
|
|
844
|
c1ccc(cc1)NCc2ccco2
|
|
845
|
c1ccc2c(c1)c3ccc(cc3o2)n4ncnn4
|
|
846
|
CCOC(=O)c1ns/c(=NCCCC#N)/n1C
|
|
847
|
c1cc(sc1)[C@H]2CCCN2CCC#N
|
|
848
|
CCS(=O)(=O)c1ccc(s1)c2cnn(c2)C
|
|
849
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
850
|
CCC1NNC(S1)C2C3CCCCC3SN2
|
|
851
|
COC(=O)C1=Nn2c3ccccc3nc2CC1
|
|
852
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
853
|
c1ccc(cc1)[S@](=O)CCSc2nncs2
|
|
854
|
CC(C)c1nc([nH]n1)CC#N
|
|
855
|
C1[C@H](O[C@H]([C@@H]1O)CO)CN2[C@@H](N=C3C2=NC(=NC3=O)[NH-])O
|
|
856
|
CCOC1=NCCCC[C@@H]1OC(=O)C
|
|
857
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
858
|
c1ccc-2c(c1)-c3c2cc(cc3)N
|
|
859
|
c1ccc(cc1)n2ncc(n2)Cn3cnc(n3)C#N
|
|
860
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
861
|
CCOC(=O)CSc1cn2c(n1)CCC2
|
|
862
|
c1ccc(cc1)c2cc3cnsc3o2
|
|
863
|
Cc1ccc(nc1)n2cccc2
|
|
864
|
c1ccc(cc1)OC(=O)N2CC(=CC=C2)CO
|
|
865
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
866
|
CC1(CC=CC1)NS(=O)(=O)C
|
|
867
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
868
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
869
|
c1cc(cnc1)[C@@]2(CCC=C2)O
|
|
870
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
871
|
CC(=O)c1ccc(s1)C#N
|
|
872
|
Cc1ccn(n1)CC/N=C/[C@@H](C(=O)C2=O)NCCCOC
|
|
873
|
c1ccc(cc1)C(=O)c2ncco2
|
|
874
|
c1ccc(cc1)c2ncc(o2)c3ncco3
|
|
875
|
c1ccc(cc1)Sc2cccs2
|
|
876
|
c1cc(oc1)c2nc([nH]n2)N
|
|
877
|
CN1CCC(=CC1)C2=NC=CC2
|
|
878
|
Cc1c(snn1)C(=O)NCc2nc(no2)C
|
|
879
|
c1cc2c(cc1Cl)ncn3c2nn(c3=O)CC(=O)N
|
|
880
|
Cc1nc(cs1)c2cc(no2)CO
|
|
881
|
CCN([C@H]1CC(=NC1=O)[O-])C(=O)c2ccc(cc2)F
|
|
882
|
CCS(=O)(=O)N1CCC[C@@H](C1)/C(=N/C2[NH]NCN2)/[O-]
|
|
883
|
[H]/N=c/n(c(c(s1)C#N)N)c2ccccc2
|
|
884
|
c1cc([nH]c1)c2c3c(c(s2)c4ccc[nH]4)OCCO3
|
|
885
|
c1cc(oc1)c2cc(no2)CO
|
|
886
|
CS(=O)(=O)N[C@@H]1CCc2c1cccc2
|
|
887
|
Cn1c(=O)c(nn(c1=O)c2ccccc2)c3nc(on3)[O-]
|
|
888
|
Cc1c2ccccc2nc(n1)NC3=N[C@@H](C=C(N3)COC)O
|
|
889
|
CC1=CC(N=c2n1c(=O)/c(=C/C(=O)OC)/[nH]2)(C)C
|
|
890
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
891
|
CC#CCCCCCCC#CC
|
|
892
|
c1cc(sc1)c2nnco2
|
|
893
|
CCOC(=O)c1cc(c(o1)N)[C@@](C(=O)OC)(C(F)(F)F)O
|
|
894
|
CC1([C@H]2[C@@H]1[C@@H]3C=C[C@H]2O3)C(=O)OCC=C
|
|
895
|
C/C(=C/Oc1ccccc1)/C=C/OC
|
|
896
|
CCn1cc(cn1)c2ccno2
|
|
897
|
[H]/N=c/n(nc(s1)C(=O)C)c2ccccc2
|
|
898
|
Cc1nnnn1c2cc3c(s2)CCCC3
|
|
899
|
COc1ccc-2c(c1)CCc3c2onc3
|
|
900
|
c1ccc(cc1)Cc2cnns2
|
|
901
|
Cc1ccc(cc1)NC2=CC(=O)NC2
|
|
902
|
C(#N)c1c(c2c(c(sc2s1)C#N)N)N
|
|
903
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
904
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
905
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
906
|
Cn1c2ccccc2c3c1c(=O)cc(o3)CO
|
|
907
|
c1cc(cc(c1)N)c2cocn2
|
|
908
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
909
|
Cc1cc2n(c3ccccc3n2c1)C
|
|
910
|
COC(=O)c1cc(coc1=[NH2+])C(=O)c2cc(ccc2O)Cl
|
|
911
|
Cc1cnc(nc1c2ncnn2C)N
|
|
912
|
CCCCS(=O)(=O)c1c(nc(s1)SC)N
|
|
913
|
c1ccc(cc1)c2cnc(n2Cc3ccco3)Cl
|
|
914
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
915
|
Cc1cc(n(n1)c2nc3ccccc3o2)N
|
|
916
|
c1cc2c(cc1c3c4ccoc4ccn3)OCCO2
|
|
917
|
CC[C@H]1[C@H](C(=O)N1)NC(=O)OC
|
|
918
|
Cc1cc(nc(n1)c2ccn[nH]2)Cl
|
|
919
|
CCCC(=O)N[C@@]1(C(=O)N(C(=N1)O)C)C(F)(F)F
|
|
920
|
Cc1nc(co1)C#Cc2cccnc2
|
|
921
|
C1CCC(CC1)SC[C@@]2(CCCC=C2)O
|
|
922
|
c1ccc(cc1)c2cc(on2)Cn3cnc(n3)C#N
|
|
923
|
CC1(Cc2c(cc3c(n2)Nc4ccccc4N=C3O)CO1)C
|
|
924
|
Cc1nc(no1)c2cccs2
|
|
925
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
926
|
c1ccc(cc1)c2nc3n(n2)CCS3
|
|
927
|
CC(=O)O[C@@H]1CC([C@H](O1)OCc2ccccc2)(F)F
|
|
928
|
CC1(C(=CC(=O)O1)SC2CCCCC2)C
|
|
929
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
930
|
C1CCC2C(C1)[C@@H]3C4CCNCC4[C@H]2O3
|
|
931
|
c1ccc(cc1)n2c3ccsc3cn2
|
|
932
|
c1cc(ccc1CC2=CCC2)Br
|
|
933
|
CC(C)Oc1cccc(c1)C(=O)Oc2nnnn2C
|
|
934
|
CCOC(=O)[C@]1(N/C(=N/C)/O1)C(F)(F)F
|
|
935
|
CCOC(=O)c1c(c([nH]n1)C)N
|
|
936
|
CC1(OC[C@@H](O1)/C=C/CO)C
|
|
937
|
c1cc(ccc1c2nc(cs2)SCC(=O)[O-])Cl
|
|
938
|
CCO[C@@H]1C[C@@H](C=CO1)c2ccccc2
|
|
939
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
940
|
Cc1ccc(c(c1)C)C2=CSc3ccccc3N2
|
|
941
|
C1CCC2C(C1)NC3=C(N2)O[C@@H](C3=O)C4CCCO4
|
|
942
|
C1CC2(C1)C[C@@](NC(=O)N2)(C(F)(F)F)O
|
|
943
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
944
|
Cc1ccc2c(c1)c(c(c(n2)SC)n3cccc3)C
|
|
945
|
Cc1cc(cs1)C2=CCCCC2
|
|
946
|
c1ccc2c(c1)CCC3=C(CC2=O)C(=O)OC3
|
|
947
|
COC1=CC(=O)O[C@@H](C1)C2CCCO2
|
|
948
|
COC(=O)C[C@@H]1Cn2c(nc(n2)C(F)(F)F)N=C1[O-]
|
|
949
|
Cc1cc(n(n1)c2nc(cc3n2ncn3)N)C
|
|
950
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
951
|
CCC/C=C/C2=C(C=CCC2)C(=O)O1
|
|
952
|
C1CCC2(CC1)C3=C(CCCC3)n4c(nc(n4)N)N2
|
|
953
|
Cc1ccc(cc1)NC(=O)COc2nc(cs2)C
|
|
954
|
Cn1ccc(=NS(=O)(=O)C)cc1
|
|
955
|
CCSC1C2C(CN[NH]2)NCN1
|
|
956
|
c1cc(oc1)c2nsc(=O)o2
|
|
957
|
c1cnc(cn1)NC2=NCCN2
|
|
958
|
Cc1cc([nH]n1)NC(=O)c2cccc(c2)Cl
|
|
959
|
c1ccn(c1)c2ccc(cc2)SCC(=O)[O-]
|
|
960
|
CC(=O)O/C=C/CC(=O)OC
|
|
961
|
Cc1cc(n2c(n1)ncn2)[O-]
|
|
962
|
C1CC2C(CC1N)C=CCS2
|
|
963
|
Cc1cc(no1)n2cnc(n2)c3cnoc3C
|
|
964
|
CC(C)(C)OC(=O)N1Cc2cn[nH]c2C1
|
|
965
|
Cc1csc(n1)N2CCc3c2cccc3
|
|
966
|
[H]/N=c/n(c(co1)C)CC(=O)c2ccc(cc2)C
|
|
967
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
968
|
Cc1cc(n(n1)CNc2c(non2)C)C
|
|
969
|
c1ccc(cc1)c2ccc(nn2)n3cnnc3
|
|
970
|
c1ccc(cc1)NC(=O)N[C@@H]2[C@@H](N=NS2)C(=O)[O-]
|
|
971
|
Cc1cc2c(o1)cc(nc2Nc3cccc(c3)Cl)C(=O)OC
|
|
972
|
CCOc1c(c(=O)c1=O)Nc2ccccc2
|
|
973
|
c1cc2c(c(c1)Cl)nc[nH]2
|
|
974
|
Cc1cnc(o1)Cn2cccn2
|
|
975
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
976
|
C1CCC2C(C1)CO[C@@H](N2)C3CCC[NH]3
|
|
977
|
c1ccc(cc1)N2Cc3ccccc3C2
|
|
978
|
CC1=NC(=O)[C@@H](C=C1c2ccc3nccn3c2)C#N
|
|
979
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
980
|
c1ccc(cc1)Cn2cnnn2
|
|
981
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
982
|
c1ccc2c(c1)N[C@@H](O2)c3cccs3
|
|
983
|
COC(=O)C[C@@H]1Cn2c(ncn2)N=C1O
|
|
984
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
985
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
986
|
Cn1cncc1COC(=O)c2ccc(cc2)Cl
|
|
987
|
Cc1cc(n(n1)CCc2nnco2)C
|
|
988
|
C1CCC2C(C1)-C3C(CNCN3)S(=O)(=O)CO2
|
|
989
|
c1cocc1c2ncc(c(n2)NCCO)F
|
|
990
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
991
|
Cc1nc(on1)NC(=O)c2ccccc2
|
|
992
|
c1ccc2c(c1)c(=O)n(nn2)CSc3nnc(o3)C4CC4
|
|
993
|
Cc1ccc(nc1)n2cnnn2
|
|
994
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
995
|
C1CCC(CC1)[S@@]2(=NC3C(CCCC3O)C=C2)=O
|
|
996
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
997
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
998
|
c1ccc(cc1)CSc2ccsc2
|
|
999
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
1000
|
C=CCOC1CCNC(N1)N
|
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